Vitas-M small molecule compound
1-[1-hydroxy-11-(3-methoxy-4-propoxyphenyl)-3,3-dimethyl-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]ethanone
Catalog ID
STL045268
SMILES CCCOc1ccc(cc1OC)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)C)cccc2)(C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C27H32N2O4 MW 448.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N2O4/c1-6-13-33-23-12-11-18(14-24(23)32-5)26-25-20(15-27(3,4)16-22(25)31)28-19-9-7-8-10-21(19)29(26)17(2)30/h7-12,14,26,31H,6,13,15-16H2,1-5H3InChIKey
HZYPSYKSPBDQBY-UHFFFAOYSA-NSynonyms
1(1hydroxy11(3methoxy4propoxyphenyl)33dimethyl23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)ethanone
MFCD03807953
ZINC000102877359
ZINC000102877361
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